Monday, December 26, 2011

All Chemical Compounds Information



Product OPENEYE NAME: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea
CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[6-[[6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinyl]amino]-1,3-benzothiazol-2-yl]urea
IUPAC NAME: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea
SYSTEMATIC NAME: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[6-[[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]amino]-1,3-benzothiazol-2-yl]urea
MOLECULAR FORMULA: C32H32ClF3N8O3S
MOLECULAR WEIGHT: 701.16149
SMILES: CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC5=C(C=C4)N=C(S5)NC(=O)NC6=CC(=C(C=C6)Cl)C(F)(F)F)OC
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Product OPENEYE NAME: 6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-pyrrolidine-2-carbonyl]azetidin-3-yl]isoindolin-1-one
CAS Name: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-5-methoxy-2-[1-[oxo-[(2S)-2-pyrrolidinyl]methyl]-3-azetidinyl]-3H-isoindol-1-one
IUPAC NAME: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-pyrrolidine-2-carbonyl]azetidin-3-yl]-3H-isoindol-1-one
SYSTEMATIC NAME: 6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-pyrrolidin-2-yl]carbonylazetidin-3-yl]-3H-isoindol-1-one
MOLECULAR FORMULA: C30H34ClN7O5S
MOLECULAR WEIGHT: 640.15286
SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=C4CN(C(=O)C4=C3)C5CN(C5)C(=O)[C@@H]6CCCN6)OC
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Product OPENEYE NAME: 6-[[5-chloro-4-(2-isopropylsulfonylanilino)pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-1-methylpyrrolidine-2-carbonyl]azetidin-3-yl]isoindolin-1-one
CAS Name: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)-2-pyrimidinyl]amino]-5-methoxy-2-[1-[[(2S)-1-methyl-2-pyrrolidinyl]-oxomethyl]-3-azetidinyl]-3H-isoindol-1-one
IUPAC NAME: 6-[[5-chloro-4-(2-propan-2-ylsulfonylanilino)pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-1-methylpyrrolidine-2-carbonyl]azetidin-3-yl]-3H-isoindol-1-one
SYSTEMATIC NAME: 6-[[5-chloranyl-4-[(2-propan-2-ylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-5-methoxy-2-[1-[(2S)-1-methylpyrrolidin-2-yl]carbonylazetidin-3-yl]-3H-isoindol-1-one
MOLECULAR FORMULA: C31H36ClN7O5S
MOLECULAR WEIGHT: 654.17944
SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=C(C=C4CN(C(=O)C4=C3)C5CN(C5)C(=O)[C@@H]6CCCN6C)OC
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Product OPENEYE NAME: 2-(dimethylamino)-1-[4-[5-isopropoxy-4-[[4-(2-isopropylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-2-methyl-phenyl]-1-piperidyl]ethanone
CAS Name: 2-(dimethylamino)-1-[4-[2-methyl-5-propan-2-yloxy-4-[[4-(2-propan-2-ylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]-1-piperidinyl]ethanone
IUPAC NAME: 2-(dimethylamino)-1-[4-[2-methyl-5-propan-2-yloxy-4-[[4-(2-propan-2-ylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperidin-1-yl]ethanone
SYSTEMATIC NAME: 2-(dimethylamino)-1-[4-[2-methyl-5-propan-2-yloxy-4-[[4-[(2-propan-2-ylsulfonylphenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperidin-1-yl]ethanone
MOLECULAR FORMULA: C33H44N8O4S
MOLECULAR WEIGHT: 648.81866
SMILES: CC1=CC(=C(C=C1C2CCN(CC2)C(=O)CN(C)C)OC(C)C)NC3=NC4=C(C=NN4)C(=N3)NC5=CC=CC=C5S(=O)(=O)C(C)C
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Product OPENEYE NAME: (2R)-1,1,1-trifluoro-3-[4-[5-isopropoxy-4-[[4-(2-isopropylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]-2-methyl-phenyl]-1-piperidyl]propan-2-ol
CAS Name: (2R)-1,1,1-trifluoro-3-[4-[2-methyl-5-propan-2-yloxy-4-[[4-(2-propan-2-ylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]-1-piperidinyl]-2-propanol
IUPAC NAME: (2R)-1,1,1-trifluoro-3-[4-[2-methyl-5-propan-2-yloxy-4-[[4-(2-propan-2-ylsulfonylanilino)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperidin-1-yl]propan-2-ol
SYSTEMATIC NAME: (2R)-1,1,1-tris(fluoranyl)-3-[4-[2-methyl-5-propan-2-yloxy-4-[[4-[(2-propan-2-ylsulfonylphenyl)amino]-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperidin-1-yl]propan-2-ol
MOLECULAR FORMULA: C32H40F3N7O4S
MOLECULAR WEIGHT: 675.76471
SMILES: CC1=CC(=C(C=C1C2CCN(CC2)C[C@H](C(F)(F)F)O)OC(C)C)NC3=NC4=C(C=NN4)C(=N3)NC5=CC=CC=C5S(=O)(=O)C(C)C
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Product OPENEYE NAME: 1-[4-[4-[[5-chloro-4-(2-methylsulfonylanilino)pyrimidin-2-yl]amino]-5-isopropoxy-2-methyl-phenyl]-1-piperidyl]-2-(dimethylamino)ethanone
CAS Name: 1-[4-[4-[[5-chloro-4-(2-methylsulfonylanilino)-2-pyrimidinyl]amino]-2-methyl-5-propan-2-yloxyphenyl]-1-piperidinyl]-2-(dimethylamino)ethanone
IUPAC NAME: 1-[4-[4-[[5-chloro-4-(2-methylsulfonylanilino)pyrimidin-2-yl]amino]-2-methyl-5-propan-2-yloxyphenyl]piperidin-1-yl]-2-(dimethylamino)ethanone
SYSTEMATIC NAME: 1-[4-[4-[[5-chloranyl-4-[(2-methylsulfonylphenyl)amino]pyrimidin-2-yl]amino]-2-methyl-5-propan-2-yloxy-phenyl]piperidin-1-yl]-2-(dimethylamino)ethanone
MOLECULAR FORMULA: C30H39ClN6O4S
MOLECULAR WEIGHT: 615.18646
SMILES: CC1=CC(=C(C=C1C2CCN(CC2)C(=O)CN(C)C)OC(C)C)NC3=NC=C(C(=N3)NC4=CC=CC=C4S(=O)(=O)C)Cl
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Product OPENEYE NAME: 2-[3-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]phenyl]-1,3,4-oxadiazole
CAS Name: 2-[3-[2-[(1R,2S)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]phenyl]-1,3,4-oxadiazole
IUPAC NAME: 2-[3-[2-[(1R,2S)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,3,4-oxadiazole
SYSTEMATIC NAME: 2-[3-[2-[(1R,2S)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]phenyl]-1,3,4-oxadiazole
MOLECULAR FORMULA: C22H24ClN5O2
MOLECULAR WEIGHT: 425.91126
SMILES: C1CN(CCC1[C@@H]2C[C@@H]2CCOC3=CC=CC(=C3)C4=NN=CO4)C5=NC=C(C=N5)Cl
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Product OPENEYE NAME: 4-[2-[(1S,2R)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]-2-fluoro-benzonitrile
CAS Name: 4-[2-[(1S,2R)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]-2-fluorobenzonitrile
IUPAC NAME: 4-[2-[(1S,2R)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-2-fluorobenzonitrile
SYSTEMATIC NAME: 4-[2-[(1S,2R)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-2-fluoranyl-benzenecarbonitrile
MOLECULAR FORMULA: C21H22ClFN4O
MOLECULAR WEIGHT: 400.876983
SMILES: C1CN(CCC1[C@H]2C[C@H]2CCOC3=CC(=C(C=C3)C#N)F)C4=NC=C(C=N4)Cl
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Product OPENEYE NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-(5-methylpyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
CAS Name: 2-methyl-6-[2-[(1S,2R)-2-[1-(5-methyl-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]-4-pyrimidinecarbonitrile
IUPAC NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-(5-methylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
SYSTEMATIC NAME: 2-methyl-6-[2-[(1S,2R)-2-[1-(5-methylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]pyrimidine-4-carbonitrile
MOLECULAR FORMULA: C21H26N6O
MOLECULAR WEIGHT: 378.47074
SMILES: CC1=CN=C(N=C1)N2CCC(CC2)[C@H]3C[C@H]3CCOC4=NC(=NC(=C4)C#N)C
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Product OPENEYE NAME: 5-chloro-2-[4-[(1S,2R)-2-[2-[3-(1,2,4-triazol-1-yl)phenoxy]ethyl]cyclopropyl]-1-piperidyl]pyrimidine
CAS Name: 5-chloro-2-[4-[(1S,2R)-2-[2-[3-(1,2,4-triazol-1-yl)phenoxy]ethyl]cyclopropyl]-1-piperidinyl]pyrimidine
IUPAC NAME: 5-chloro-2-[4-[(1S,2R)-2-[2-[3-(1,2,4-triazol-1-yl)phenoxy]ethyl]cyclopropyl]piperidin-1-yl]pyrimidine
SYSTEMATIC NAME: 5-chloranyl-2-[4-[(1S,2R)-2-[2-[3-(1,2,4-triazol-1-yl)phenoxy]ethyl]cyclopropyl]piperidin-1-yl]pyrimidine
MOLECULAR FORMULA: C22H25ClN6O
MOLECULAR WEIGHT: 424.9265
SMILES: C1CN(CCC1[C@@H]2C[C@@H]2CCOC3=CC=CC(=C3)N4C=NC=N4)C5=NC=C(C=N5)Cl
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Product OPENEYE NAME: 4-[2-[(1S,2R)-2-[1-(5-chloropyrimidin-2-yl)-4-piperidyl]cyclopropyl]ethoxy]-N-cyclopropyl-2-fluoro-benzamide
CAS Name: 4-[2-[(1S,2R)-2-[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]cyclopropyl]ethoxy]-N-cyclopropyl-2-fluorobenzamide
IUPAC NAME: 4-[2-[(1S,2R)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-N-cyclopropyl-2-fluorobenzamide
SYSTEMATIC NAME: 4-[2-[(1S,2R)-2-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]-N-cyclopropyl-2-fluoranyl-benzamide
MOLECULAR FORMULA: C24H28ClFN4O2
MOLECULAR WEIGHT: 458.956123
SMILES: C1CC1NC(=O)C2=C(C=C(C=C2)OCC[C@@H]3C[C@@H]3C4CCN(CC4)C5=NC=C(C=N5)Cl)F
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Product OPENEYE NAME: 2-[4-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-1-piperidyl]ethyl dihydrogen phosphate
CAS Name: 2-[4-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-1-piperidinyl]ethyl dihydrogen phosphate
IUPAC NAME: 2-[4-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]piperidin-1-yl]ethyl dihydrogen phosphate
SYSTEMATIC NAME: 2-[4-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]piperidin-1-yl]ethyl dihydrogen phosphate
MOLECULAR FORMULA: C29H34N3O7PS
MOLECULAR WEIGHT: 599.634921
SMILES: CC1=CN=C2C(=C1)C3=C(C=CC(=C3N2)OCC4CCN(CC4)CCOP(=O)(O)O)C5=CC(=CC=C5)S(=O)(=O)C6CC6
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Product OPENEYE NAME: [1-[3-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl]-4-piperidyl]methyl dihydrogen phosphate
CAS Name: [1-[3-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl]-4-piperidinyl]methyl dihydrogen phosphate
IUPAC NAME: [1-[3-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl]piperidin-4-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [1-[3-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxy]propyl]piperidin-4-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C30H36N3O7PS
MOLECULAR WEIGHT: 613.661501
SMILES: CC1=CN=C2C(=C1)C3=C(C=CC(=C3N2)OCCCN4CCC(CC4)COP(=O)(O)O)C5=CC(=CC=C5)S(=O)(=O)C6CC6
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Product OPENEYE NAME: 2-[4-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-1-piperidyl]ethyl dihydrogen phosphate
CAS Name: 2-[4-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-1-piperidinyl]ethyl dihydrogen phosphate
IUPAC NAME: 2-[4-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]piperidin-1-yl]ethyl dihydrogen phosphate
SYSTEMATIC NAME: 2-[4-[[5-(3-ethylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]piperidin-1-yl]ethyl dihydrogen phosphate
MOLECULAR FORMULA: C28H34N3O7PS
MOLECULAR WEIGHT: 587.624221
SMILES: CCS(=O)(=O)C1=CC=CC(=C1)C2=C3C4=CC(=CN=C4NC3=C(C=C2)OCC5CCN(CC5)CCOP(=O)(O)O)C
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Product OPENEYE NAME: 2-[(2S)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
CAS Name: 2-[(2S)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-4-morpholinyl]ethyl dihydrogen phosphate
IUPAC NAME: 2-[(2S)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
SYSTEMATIC NAME: 2-[(2S)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
MOLECULAR FORMULA: C28H32N3O8PS
MOLECULAR WEIGHT: 601.607741
SMILES: CC1=CN=C2C(=C1)C3=C(C=CC(=C3N2)OC[C@@H]4CN(CCO4)CCOP(=O)(O)O)C5=CC(=CC=C5)S(=O)(=O)C6CC6
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Product OPENEYE NAME: 2-[(2R)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
CAS Name: 2-[(2R)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]-4-morpholinyl]ethyl dihydrogen phosphate
IUPAC NAME: 2-[(2R)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
SYSTEMATIC NAME: 2-[(2R)-2-[[5-(3-cyclopropylsulfonylphenyl)-3-methyl-9H-pyrido[2,3-b]indol-8-yl]oxymethyl]morpholin-4-yl]ethyl dihydrogen phosphate
MOLECULAR FORMULA: C28H32N3O8PS
MOLECULAR WEIGHT: 601.607741
SMILES: CC1=CN=C2C(=C1)C3=C(C=CC(=C3N2)OC[C@H]4CN(CCO4)CCOP(=O)(O)O)C5=CC(=CC=C5)S(=O)(=O)C6CC6
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MOLECULAR FORMULA: C31H26N2O7
MOLECULAR WEIGHT: 538.54734
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)/C=C/C6=CC(=C(C=C6)OC)OC
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MOLECULAR FORMULA: C32H28N2O8
MOLECULAR WEIGHT: 568.57332
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)/C=C/C6=CC(=C(C(=C6)OC)OC)OC
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MOLECULAR FORMULA: C29H21N3O7
MOLECULAR WEIGHT: 523.49294
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)/C=C/C6=CC(=CC=C6)[N+](=O)[O-]
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MOLECULAR FORMULA: C29H21ClN2O5
MOLECULAR WEIGHT: 512.94044
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)/C=C/C6=CC=CC=C6Cl
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MOLECULAR FORMULA: C29H21FN2O5
MOLECULAR WEIGHT: 496.485843
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)/C=C/C6=CC=C(C=C6)F
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Product OPENEYE NAME: 2-[3-(3-chlorophenyl)-1-oxo-7-[4-(1-piperidyl)-1-piperidyl]pyrrolo[1,2-a]pyrazin-2-yl]-N-isopropyl-acetamide
CAS Name: 2-[3-(3-chlorophenyl)-1-oxo-7-[4-(1-piperidinyl)-1-piperidinyl]-2-pyrrolo[1,2-a]pyrazinyl]-N-propan-2-ylacetamide
IUPAC NAME: 2-[3-(3-chlorophenyl)-1-oxo-7-(4-piperidin-1-ylpiperidin-1-yl)pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
SYSTEMATIC NAME: 2-[3-(3-chlorophenyl)-1-oxidanylidene-7-(4-piperidin-1-ylpiperidin-1-yl)pyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-yl-ethanamide
MOLECULAR FORMULA: C28H36ClN5O2
MOLECULAR WEIGHT: 510.07074
SMILES: CC(C)NC(=O)CN1C(=CN2C=C(C=C2C1=O)N3CCC(CC3)N4CCCCC4)C5=CC(=CC=C5)Cl
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If you buy this product, please go to Chemmol.com, Chemalog.com , ChemLookup.com to find suppliers!

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